5-nitro-N2-[[(2R)-oxolan-2-yl]methyl]-6-pyrrolidin-1-yl-pyrimidine-2,4-diamine

Systemtic Name: 5-nitro-N2-[[(2R)-oxolan-2-yl]methyl]-6-pyrrolidin-1-yl-pyrimidine-2,4-diamine Openeye Name: 5-nitro-6-pyrrolidin-1-yl-N2-[[(2R)-tetrahydrofuran-2-yl]methyl]pyrimidine-2,4-diamine CAS Name: 5-nitro-N2-[[(2R)-2-oxolanyl]methyl]-6-(1-pyrrolidinyl)pyrimidine-2,4-diamine IUPAC Name: 5-nitro-2-N-[[(2R)-oxolan-2-yl]methyl]-6-pyrrolidin-1-ylpyrimidine-2,4-diamine Traditional Name: (4-amino-5-nitro-6-pyrrolidino-pyrimidin-2-yl)-[[(2R)-tetrahydrofuran-2-yl]methyl]amine Formula: C13H20N6O3 MolecularWeight: 308.3363

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C(=NC(=N2)NCC3CCCO3)N)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C2=C(C(=NC(=N2)NC[C@H]3CCCO3)N)[N+](=O)[O-]

InChI

InChI=1S/C13H20N6O3/c14-11-10(19(20)21)12(18-5-1-2-6-18)17-13(16-11)15-8-9-4-3-7-22-9/h9H,1-8H2,(H3,14,15,16,17)/t9-/m1/s1